2-diethylaminoethyl 4-[3-[4-(2-diethylaminoethyloxycarbonyl)phenyl]propyl]benzoate hydrochloride

Systemtic Name: 2-diethylaminoethyl 4-[3-[4-(2-diethylaminoethyloxycarbonyl)phenyl]propyl]benzoate hydrochloride Openeye Name: 2-diethylaminoethyl 4-[3-[4-(2-diethylaminoethyloxycarbonyl)phenyl]propyl]benzoate hydrochloride CAS Name: 4-[3-[4-[2-diethylaminoethyloxy(oxo)methyl]phenyl]propyl]benzoic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 4-[3-[4-(2-diethylaminoethyloxycarbonyl)phenyl]propyl]benzoate hydrochloride Traditional Name: 4-[3-[4-(2-diethylaminoethyloxycarbonyl)phenyl]propyl]benzoic acid 2-diethylaminoethyl ester hydrochloride Formula: C29H43ClN2O4 MolecularWeight: 519.11572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)CCCC2=CC=C(C=C2)C(=O)OCCN(CC)CC.Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)CCCC2=CC=C(C=C2)C(=O)OCCN(CC)CC.Cl

InChI

InChI=1S/C29H42N2O4.ClH/c1-5-30(6-2)20-22-34-28(32)26-16-12-24(13-17-26)10-9-11-25-14-18-27(19-15-25)29(33)35-23-21-31(7-3)8-4;/h12-19H,5-11,20-23H2,1-4H3;1H